[2-[(E)-[(4-cyanophenyl)carbonylhydrazinylidene]methyl]phenyl] benzenesulfonate

Systemtic Name: [2-[(E)-[(4-cyanophenyl)carbonylhydrazinylidene]methyl]phenyl] benzenesulfonate Openeye Name: [2-[(E)-[(4-cyanobenzoyl)hydrazono]methyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-[(E)-[[(4-cyanophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-[(E)-[(4-cyanobenzoyl)hydrazinylidene]methyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-[(E)-[(4-cyanobenzoyl)hydrazono]methyl]phenyl] ester Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C=NNC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2/C=N/NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H15N3O4S/c22-14-16-10-12-17(13-11-16)21(25)24-23-15-18-6-4-5-9-20(18)28-29(26,27)19-7-2-1-3-8-19/h1-13,15H,(H,24,25)/b23-15+